2-[[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-cyclopentyl-ethanamide

Systemtic Name: 2-[[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-cyclopentyl-ethanamide Openeye Name: 2-[[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-cyclopentyl-acetamide CAS Name: 2-[[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-1,2,4-triazol-3-yl]thio]-N-cyclopentylacetamide IUPAC Name: 2-[[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-cyclopentylacetamide Traditional Name: N-cyclopentyl-2-[(4-methyl-5-piperonyl-1,2,4-triazol-3-yl)thio]acetamide Formula: C18H22N4O3S MolecularWeight: 374.45728

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC(=O)NC2CCCC2)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CN1C(=NN=C1SCC(=O)NC2CCCC2)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C18H22N4O3S/c1-22-16(9-12-6-7-14-15(8-12)25-11-24-14)20-21-18(22)26-10-17(23)19-13-4-2-3-5-13/h6-8,13H,2-5,9-11H2,1H3,(H,19,23)